[4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] pyridine-2-carboxylate

Systemtic Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] pyridine-2-carboxylate Openeye Name: [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(3,4-dimethylphenyl)sulfonyl-methylamino]phenyl] pyridine-2-carboxylate Traditional Name: picolinic acid [4-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=CC=N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC(=O)C3=CC=CC=N3)C

InChI

InChI=1S/C21H20N2O4S/c1-15-7-12-19(14-16(15)2)28(25,26)23(3)17-8-10-18(11-9-17)27-21(24)20-6-4-5-13-22-20/h4-14H,1-3H3